Predicted GC-MS Spectrum - 20-Deoxynarasin GC-MS (TBDMS_1_2) - 70eV, Positive (HMDB0030449)
Spectrum Details
| HMDB ID: | HMDB0030449 |
|---|---|
| Compound Name: | 20-Deoxynarasin |
| Derivative IUPAC Name: | Not Available |
| Derivative SMILES: | CCC(C(=O)O)C1OC(C(C)C(O)C(C)C(=O)C(CC)C2OC3(C=CCC4(CCC(C)(C5CCC(CC)(O[Si](C)(C)C(C)(C)C)C(C)O5)O4)O3)C(C)CC2C)C(C)CC1C |
| Derivative InChIKey: | Not Available |
| Spectrum Type: | Predicted GC-MS Spectrum - 20-Deoxynarasin GC-MS (TBDMS_1_2) - 70eV, Positive |
| Splash Key: | Not Available |
| Notes: | This is a predicted spectrum, and it should only be used as a guide. Further evidence is required to confirm identification. |
Spectrum View
Experimental Conditions
| Ionization Mode: | Positive |
|---|---|
| Ionization Energy: | 70 eV |
| Chromatography Type: | Gas Chromatography Column (GC) |
| Instrument Type: | Single quadrupole, spectrum predicted by CFM-ID(EI) |
| Mass Resolution: | 0.0001 Da |
| Molecular Formula: | C43H72O10 |
| Molecular Weight (Monoisotopic Mass): | 748.5125 Da |
| Derivative Type: | TBDMS_1_2 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CCC(C(=O)O)C1OC(C(C)C(O)C(C)C(=O)C(CC)C2OC3(C=CCC4(CCC(C)(C5CCC(CC)(O[Si](C)(C)C(C)(C)C)C(C)O5)O4)O3)C(C)CC2C)C(C)CC1C)
Documentation
| Document Description | Download | File Size |
|---|---|---|
| List of m/z values for the spectrum (TXT) | Download file | 752 Bytes |
| mzML formatted file (MZML) | Download file | 4.66 KB |
References
Not Available